N-[(2S)-1-[[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-[[(4S)-6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-1-[[(4S)-6-fluorothiochroman-4-yl]carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide CAS Name: N-[(2S)-1-[[(4S)-6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl]amino]-3-methyl-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-[[(4S)-6-fluoro-3,4-dihydro-2H-thiochromen-4-yl]amino]-3-methyl-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-1-[[(4S)-6-fluorothiochroman-4-yl]carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide Formula: C19H21FN2O2S2 MolecularWeight: 392.510643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CCSC2=C1C=C(C=C2)F)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)[C@@H](C(=O)N[C@H]1CCSC2=C1C=C(C=C2)F)NC(=O)C3=CC=CS3

InChI

InChI=1S/C19H21FN2O2S2/c1-11(2)17(22-18(23)16-4-3-8-25-16)19(24)21-14-7-9-26-15-6-5-12(20)10-13(14)15/h3-6,8,10-11,14,17H,7,9H2,1-2H3,(H,21,24)(H,22,23)/t14-,17-/m0/s1